N-[(3-chloranyl-2-phenyl-quinoxalin-6-yl)methyl]-3,4,5-trimethoxy-N-prop-2-ynyl-aniline

Systemtic Name: N-[(3-chloranyl-2-phenyl-quinoxalin-6-yl)methyl]-3,4,5-trimethoxy-N-prop-2-ynyl-aniline Openeye Name: N-[(3-chloro-2-phenyl-quinoxalin-6-yl)methyl]-3,4,5-trimethoxy-N-prop-2-ynyl-aniline CAS Name: N-[(3-chloro-2-phenyl-6-quinoxalinyl)methyl]-3,4,5-trimethoxy-N-prop-2-ynylaniline IUPAC Name: N-[(3-chloro-2-phenylquinoxalin-6-yl)methyl]-3,4,5-trimethoxy-N-prop-2-ynylaniline Traditional Name: (3-chloro-2-phenyl-quinoxalin-6-yl)methyl-propargyl-(3,4,5-trimethoxyphenyl)amine Formula: C27H24ClN3O3 MolecularWeight: 473.95076

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)N(CC#C)CC2=CC3=C(C=C2)N=C(C(=N3)Cl)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)N(CC#C)CC2=CC3=C(C=C2)N=C(C(=N3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C27H24ClN3O3/c1-5-13-31(20-15-23(32-2)26(34-4)24(16-20)33-3)17-18-11-12-21-22(14-18)30-27(28)25(29-21)19-9-7-6-8-10-19/h1,6-12,14-16H,13,17H2,2-4H3